SCHEMBL7366232

SCHEMBL7366232

CC#CCOc1ccc(S(=O)(=O)CNCCC(=O)NO)cc1.CC#CCOc1ccc(S(=O)(=O)N(C)CCC(=O)O)cc1

nearest known ligand 0.75

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 20/20 0.75
MMP13 P45452 16/20 0.75
MMP1 P03956 13/20 0.75
MMP9 P14780 13/20 0.75
MMP2 P08253 5/20 0.63
MMP7 P09237 2/20 0.63
MMP8 P22894 2/20 0.63
MMP14 P50281 2/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7366239 0.90 ADAM17 (0.94) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL3940235 0.88 ADAM17 (0.71) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL3940240 0.86 ADAM17 (1.00) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL7354960 0.85 ADAM17 (0.80) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL6502322 0.78 ADAM17 (1.00) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL6502320 0.78 ADAM17 (0.70) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL6508472 0.74 ADAM17 (0.76) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL3944045 0.74 ADAM17 (1.00) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL7356913 0.72 ADAM17 (0.69) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL7366235 0.72 ADAM17 (0.68) ADAM17MMP13MMP1MMP9MMP2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1147078-A1 ACETYLENIC (BETA)-SULFONAMIDO AND PHOSPHINIC ACID AMIDE HYDROXAMIC ACID TACE INHIBITORS American Cyanamid Company (US) 2001-10-24 EP disclosed
WO-2000044711-A1 ACETYLENIC $G(b)-SULFONAMIDO AND PHOSPHINIC ACID AMIDE HYDROXAMIC ACID TACE INHIBITORS AMERICAN CYANAMID COMPANY (US) 2000-08-03 WO disclosed